Cas no 22414-26-2 (2-Phenyl-propionyl Chloride)

2-Phenyl-propionyl Chloride (C9H9ClO) is a versatile acyl chloride derivative used primarily as an intermediate in organic synthesis. Its reactive carbonyl chloride group enables efficient acylation reactions, making it valuable for producing pharmaceuticals, agrochemicals, and fine chemicals. The compound exhibits high purity and stability under controlled conditions, ensuring consistent performance in reactions such as esterification and amidation. Its phenyl substituent enhances reactivity in electrophilic processes while allowing selective functionalization. Proper handling is essential due to its moisture sensitivity and corrosive nature. Suitable for laboratory and industrial applications, 2-Phenyl-propionyl Chloride is a reliable reagent for synthesizing complex organic molecules with precision.
2-Phenyl-propionyl Chloride structure
2-Phenyl-propionyl Chloride structure
Product Name:2-Phenyl-propionyl Chloride
CAS No:22414-26-2
MF:C9H9ClO
MW:168.620161771774
MDL:MFCD03424723
CID:851033
PubChem ID:329761273
Update Time:2025-05-24

2-Phenyl-propionyl Chloride Chemical and Physical Properties

Names and Identifiers

    • 2-Phenylpropanoyl chloride
    • 2-Phenylpropionyl chloride
    • 2-PHENYL-PROPIONYL CHLORIDE
    • Benzeneacetyl chloride, a-methyl-
    • Hydratropoyl chloride
    • MFCD03424723
    • alpha-phenylpropionic acid chloride
    • FS-6051
    • (+/-)-2-phenylpropionic acid chloride
    • SCHEMBL720886
    • AKOS006282315
    • J-014699
    • DTXSID20375141
    • 2-phenylpropionic acid chloride
    • XAA41426
    • 22414-26-2
    • 2-Phenylpropanoylchloride
    • 2-Phenylpropionyl chloride, >=95%
    • 2-Phenyl-propionyl Chloride
    • MDL: MFCD03424723
    • Inchi: 1S/C9H9ClO/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3
    • InChI Key: FOTITZRWZUAVPH-UHFFFAOYSA-N
    • SMILES: ClC(C(C)C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 152.03937
  • Monoisotopic Mass: 168.0341926g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 139
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.9
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 0

2-Phenyl-propionyl Chloride Security Information

  • Symbol: GHS05
  • Signal Word:Danger
  • Hazard Statement: H314
  • Warning Statement: P280-P305+P351+P338-P310
  • Hazardous Material transportation number:UN 3265 8 / PGII
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: 26-36/37/39-45
  • Hazardous Material Identification: C
  • HazardClass:8
  • PackingGroup:

2-Phenyl-propionyl Chloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Fluorochem
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abcr
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Additional information on 2-Phenyl-propionyl Chloride

Recent Advances in the Application of 2-Phenyl-propionyl Chloride (CAS 22414-26-2) in Chemical and Pharmaceutical Research

2-Phenyl-propionyl Chloride (CAS 22414-26-2) is a key intermediate in the synthesis of various pharmaceutical compounds and fine chemicals. Recent studies have highlighted its versatility in organic synthesis, particularly in the formation of esters, amides, and other derivatives that serve as building blocks for drug development. This research brief consolidates the latest findings on the applications, mechanisms, and innovations surrounding this compound, providing a comprehensive overview for professionals in the chemical and pharmaceutical industries.

A significant focus of current research involves the use of 2-Phenyl-propionyl Chloride in the synthesis of non-steroidal anti-inflammatory drugs (NSAIDs). Recent publications in journals such as the Journal of Medicinal Chemistry and Organic Letters have demonstrated its efficacy in creating novel NSAID derivatives with improved pharmacokinetic properties. For instance, a 2023 study utilized this compound to develop a series of propionic acid derivatives, showing enhanced selectivity for COX-2 inhibition while minimizing gastrointestinal side effects.

In addition to its pharmaceutical applications, 2-Phenyl-propionyl Chloride has been employed in material science. A breakthrough study published in Advanced Materials (2024) reported its use in the synthesis of polymer coatings with tunable hydrophobicity, which have potential applications in biomedical devices. The compound's reactivity with hydroxyl and amino groups makes it a valuable tool for surface functionalization, enabling the development of smart materials with targeted properties.

Mechanistic insights into the reactions involving 2-Phenyl-propionyl Chloride have also been a subject of recent investigations. Computational chemistry studies, leveraging density functional theory (DFT), have elucidated the energy profiles and transition states of its acylation reactions. These findings, published in The Journal of Physical Chemistry A, provide a deeper understanding of reaction kinetics and selectivity, facilitating the design of more efficient synthetic routes.

From an industrial perspective, advancements in the scalable production of 2-Phenyl-propionyl Chloride have been reported. A 2024 patent application detailed an optimized continuous-flow process that enhances yield and reduces waste compared to traditional batch methods. This innovation addresses growing demand while aligning with green chemistry principles, as highlighted in the patent documentation and related industry reports.

Ongoing clinical research has explored prodrug formulations derived from 2-Phenyl-propionyl Chloride. Phase I trials for a new analgesic prodrug, which utilizes this compound as a promoiety, have shown promising results in terms of bioavailability and controlled release profiles. These developments suggest expanding therapeutic applications in pain management, with further clinical evaluations anticipated in the coming years.

In conclusion, 2-Phenyl-propionyl Chloride (CAS 22414-26-2) continues to be a compound of significant interest across multiple research domains. Its applications span from pharmaceutical synthesis to advanced materials, supported by both experimental and theoretical advancements. The compound's versatility and the recent innovations in its utilization underscore its enduring relevance in chemical and biomedical research, offering numerous opportunities for future developments and applications.

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